methyl 2-methoxy-5-[[4-oxidanyl-6-(quinolin-2-ylmethoxy)-3,4-dihydro-2H-chromen-3-yl]methyl]benzoate

Systemtic Name: methyl 2-methoxy-5-[[4-oxidanyl-6-(quinolin-2-ylmethoxy)-3,4-dihydro-2H-chromen-3-yl]methyl]benzoate Openeye Name: methyl 5-[[4-hydroxy-6-(2-quinolylmethoxy)chroman-3-yl]methyl]-2-methoxy-benzoate CAS Name: 5-[[4-hydroxy-6-(2-quinolinylmethoxy)-3,4-dihydro-2H-1-benzopyran-3-yl]methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[[4-hydroxy-6-(quinolin-2-ylmethoxy)-3,4-dihydro-2H-chromen-3-yl]methyl]-2-methoxybenzoate Traditional Name: 5-[[4-hydroxy-6-(2-quinolylmethoxy)chroman-3-yl]methyl]-2-methoxy-benzoic acid methyl ester Formula: C29H27NO6 MolecularWeight: 485.52778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2COC3=C(C2O)C=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2COC3=C(C2O)C=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)C(=O)OC

InChI

InChI=1S/C29H27NO6/c1-33-26-11-7-18(14-24(26)29(32)34-2)13-20-16-36-27-12-10-22(15-23(27)28(20)31)35-17-21-9-8-19-5-3-4-6-25(19)30-21/h3-12,14-15,20,28,31H,13,16-17H2,1-2H3